(2S)-2-[(1S)-1-[(4S,5R,6S,8S,9S,10R,13S,14S,17R)-6-[[(4S,5R,6S,8S,9S,10R,13S,14S,17R)-4,5-dihydroxy-17-[(1S)-1-[(2S)-5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-10,13-dimethyl-1-oxo-6,7,8,9,11,12,14,15,16,17-decahydro-4H-cyclopenta[a]phenanthren-6-yl]sulfanyl]-4,5-dihydroxy-10,13-dimethyl-1-oxo-6,7,8,9,11,12,14,15,16,17-decahydro-4H-cyclopenta[a]phenanthren-17-yl]ethyl]-5-(hydroxymethyl)-4-methyl-2,3-dihydropyran-6-one
Grundinformationen
- Standard-SMILES
CC1=C(CO)C(=O)O[C@H]([C@@H](C)[C@H]2CC[C@H]3[C@@H]4C[C@H](S[C@H]5C[C@H]6[C@@H]7CC[C@H]([C@H](C)[C@@H]8CC(C)=C(CO)C(=O)O8)[C@@]7(C)CC[C@@H]6[C@@]6(C)C(=O)C=C[C@H](O)[C@@]56O)[C@]5(O)[C@@H](O)C=CC(=O)[C@]5(C)[C@H]4CC[C@]23C)C1- InChIKey
OCURLCGFNKYNMO-GZBQOVFZSA-N- Summenformel
- C56H78O12S
- Durchschnittliche Molmasse
- 975,3 g/mol
- Monoisotopische Masse
- 974,52139894
Überblick
OCURLCGFNKYNMO-GZBQOVFZSA-N has been reported in Withania somnifera with data available.