빈블라스틴 황산염, 모노수화물

Vinblastine Sulfate

HCID 5388983

기본 정보

CAS
143-67-9
표준 SMILES
CC[C@]1(O)C[C@@H]2CN(CCc3c([nH]c4ccccc34)[C@@](C(=O)OC)(c3cc4c(cc3OC)N(C)[C@H]3[C@@](O)(C(=O)OC)[C@H](OC(C)=O)[C@]5(CC)C=CCN6CC[C@]43[C@@H]65)C2)C1.O=S(=O)(O)O
InChIKey
KDQAABAKXDWYSZ-PNYVAJAMSA-N
분자식
C46H58N4O9.H2O4S
평균 분자량
909.1 g/mol
단동위원소 질량
908.38775898

개요

Vinblastine Sulfate can cause developmental toxicity according to state or federal government labeling requirements.

이름 및 식별자

우선 이름
Vinblastine Sulfate
IUPAC
methyl (1R,9R,10S,11R,12R,19R)-11-acetyloxy-12-ethyl-4-[(13S,15R,17S)-17-ethyl-17-hydroxy-13-methoxycarbonyl-1,11-diazatetracyclo[13.3.1.04,12.05,10]nonadeca-4(12),5,7,9-tetraen-13-yl]-10-hydroxy-5-methoxy-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraene-10-carboxylate;sulfuric acid
현지명
빈블라스틴 황산염, 모노수화물
영어명
Vinblastine sulfate
분자식
C46H60N4O13S
분자량
909.06

이름 및 동의어

Vinblastine sulfate143-67-9VelsarAlkaban-aqVinblastine sulphateVLB monosulfate29060-LEVincaleucoblastine sulfateVinblastini sulfasNSC-49842N00W22YO2BVincaleukoblastine, sulfate (1:1) (salt)
이름 더 보기
빈블라스틴황산염,모노수화물빈블라스틴황산염,모노수화물VINBLASTINE SULFATE SALTVLBexalvelbanVINCALEUKOBLASTINEvelbensc49842
29060LE29060 LENSC 49842DTXSID601017133CHEBI:9984Vinblast,lederleSulfate, VinblastineRefChem:56475

데이터베이스 식별자

CAS
143-67-9
PubChem CID
5388983
DTXSID
DTXSID601017133
ChEMBL
CHEMBL378544
UNII
N00W22YO2B
EC Number
205-606-0

물성

구조 계산 물성

극성 표면적
237 Ų
수소 결합 공여자 수
5
수소 결합 수용자 수
16
회전 가능 결합 수
10
무거운 원자 수
64

실험 및 물리화학적 성질

Solubilitygreater than or equal to 10 mg/mL at 76.1 °F (NTP, 1992)
Human Drugs · 3건

Breast Feeding; Lactation; Milk, Human; Antineoplastic Agents; Antimitotic Agents

FDA approved drugs -> Active ingredient

FDA approved drugs -> Active ingredient

Melting Point543 to 545 °F (NTP, 1992)
Physical DescriptionVinblastine sulfate appears as an anticancer drug. White to slightly yellow crystalline powder. (NTP, 1992)
Collision Cross Section278.5 Ų [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]

물리화학적 성질

녹는점
267 °C · 267 °C (dec.)(lit.)
저장 조건
2 · 2-8°C
용해도
2 O: · H2O: 10 mg/mL
물리적 상태
가루
산도 계수 (pKa)
7.4 · 7.4
색상
하얀색

화학적 성질

Vinblastine sulfate is a white to off-white crystalline powder that is freely soluble in water, soluble in methane, and slightly soluble in ethanol. Its empiric formula is C46H58N4O9.H2SO4 , and it has a molecular weight of 909.07.

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H302 (99%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 98 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationHazard Traits - Developmental Toxicity
Other Safety InformationIMAP assessments - Vincaleukoblastine, sulfate (1:1) (salt): Environment tier I assessment
DOT LabelPoison
Fire HazardsFlash point data for this chemical are not available; however it is probably combustible. (NTP, 1992)
Health Hazards · 1건

SYMPTOMS: Symptoms of exposure to this chemical include temporary mental depression, paresthesias, loss of deep-tendon reflexes, headache, convulsions, psychoses; dysfunction of the autonomic nervous system, with marked constipation, paralytic ileus, urinary retention, bilateral pain and tenderness of the parotid glands associated with dryness of the mouth, sinus tachycardia; nausea, vomiting, anorexia, diarrhea; loss of hair, vesicular mucositis of the mouth, and dermatitis. (NTP, 1992)

Reactive GroupAlcohols and Polyols

안전 및 보호

Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid · 1건

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

Nonfire Spill Response · 1건

SMALL SPILLS AND LEAKAGE: If you spill this chemical, you should dampen the solid spill material with water, then transfer the dampened material to a suitable container. Use absorbent paper dampened with water to pick up any remaining material. Seal your contaminated clothing and the absorbent paper in a vapor-tight plastic bag for eventual disposal. Wash all contaminated surfaces with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Isolation and EvacuationExcerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]:
Personal Protective Equipment (PPE) · 1건

RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)

독성 정보

Carcinogen Classification · 5건

Vinblastine sulfate

Group 3: Not classifiable as to its carcinogenicity to humans

Volume 26: (1981) Some Antineoplastic and Immunosuppressive Agents

1987

1987

Drug Induced Liver Injury · 6건

Drug Induced Liver Injury Rank (DILIrank 2.0)

Vinblastine sulfate

vLess-DILI-concern

0

No match

DOI:10.1016/j.drudis.2016.02.015

Effects During Pregnancy and Lactation◉ Summary of Use during Lactation

안전 데이터

wgk
3
rtecs
YY8400000
ridadr
1544
독성
LD50 i.v. in mice: 9.5 mg/kg (Lu, Meistrich)
HS 번호
29399990
risk_code
22-37/38-41-61-36/37/38-63-23/24/25

화학 및 산업

약리 정보

FDA Pharmacological Classification · 2건

VINBLASTINE SULFATE

Vinca Alkaloid [EPC]; Vinca Alkaloids [CS]

MeSH Pharmacological Classification · 2건

Agents obtained from higher plants that have demonstrable cytostatic or antineoplastic activity.

Agents that interact with TUBULIN to inhibit or promote polymerization of MICROTUBULES.

응용 분야 · 3건

개요Vinblastine sulfate is the salt of an alkaloid extracted from Vinca rosea Linn., a common flowering herb known as the periwinkle (more properly known as Catharanthus roseus G. Don). Previously, the generic name was vincaleukoblastine, abbreviated VLB. It is a stathmokinetic oncolytic agent. When treated in vitro with this preparation, growing cells are arrested in metaphase. Chemical and physical evidence indicate that vinblastine sulfate is a dimeric alkaloid containing both indole and dihydroindole moieties.

용도Anticancer agent; microtubule disrupter; Induces apoptosis.Vinblastine sulfate is therapeutically used as an antineoplastic. It is also used in the treatment of Hodgkin disease, choriocarcinoma, acute and chronic leukemias.

일반 설명Vinblastine Sulfate is the sulfate salt of vinblastine, a natural alkaloid isolated from the plant Catharanthus roseus (Madagascar periwinkle) with antineoplastic properties. Vinblastine disrupts microtubule formation and function during mitosis and interferes with glutamic acid metabolism. (NCI04)

상·하류 제품 정보

공급사100 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
北京华美互利生物化工010-56205725 · [email protected]
成都普瑞法科技开发有限公司+86-028-82633397 18982077548 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]

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