Basic information
- CAS
155899-92-6- Standard SMILES
COc1ccc(CCO[C@@H]2O[C@H](CO)[C@@H](OC(=O)/C=C\c3ccc(O)c(OC)c3)[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H]2O)cc1O- InChIKey
WLWAYPFRKDSFCL-LDMHTXDHSA-N- Molecular formula
- C31H40O15
- Average molar mass
- 652.6 g/mol
Overview
cis-Martynoside has been reported in Pedicularis densispica, Salvia officinalis, and other organisms with data available.
Names & identifiers
- Preferred name
- cis-Martynoside
- IUPAC
- [(2R,3R,4R,5R,6R)-5-hydroxy-6-[2-(3-hydroxy-4-methoxyphenyl)ethoxy]-2-(hydroxymethyl)-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (Z)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
- English name
- cis-Martynoside
- Molecular formula
- C31H40O15
- Molecular weight
- 652.65
Names & synonyms
cis-Martynoside155899-92-6orb1680989TN5745AKOS040762901H63255-D-Glucopyranoside, 2-(3-hydroxy-4-methoxyphenyl)ethyl 3-O-(6-deoxy--L-mannopyranosyl)-, 4-[3-(4-hydroxy-3-methoxyphenyl)-2-propenoate], (E)-β-D-Glucopyranoside, 2-(3-hydroxy-4-methoxyphenyl)ethyl 3-O-(6-deoxy-α-L-mannopyranosyl)-, 4-[(2Z)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoate]
Database identifiers
- CAS
155899-92-6- Nikkaji
- J606.360H
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 223 Ų
- Hydrogen bond donors
- 7
- Hydrogen bond acceptors
- 15
- Rotatable bonds
- 13
- Heavy atoms
- 46
- Formal charge
- 0
- Complexity
- 968
Physicochemical properties
- Boiling point
- 865.1 · 865.1±65.0 °C(Predicted)
- Density
- 1.48 · 1.48±0.1 g/cm3(Predicted)
- pka
- 9.73 · 9.73±0.31(Predicted)
Chemistry & industry
Suppliers8 total
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
云南西力生物技术股份有限公司0871-65217109 · [email protected]
佛山宝诺生物科技有限公司0757-85921206 18520245316 · [email protected]
上海博湖生物科技有限公司021-57763112 13585886131 · [email protected]
上海莫奇生物科技有限公司13341702378 · [email protected]
四川百奥克睿生物科技有限公司28-86-28-8543-3893 13260669172 · [email protected]
北京谱析科技有限公司400-808-7372 13161114455 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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