(2S,3S,4S,5R,6S)-6-[[(17R)-17-[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxy-oxane-2-carboxylic acid
Molecular Formula:
C32H45NO13
InChI: InChI=1/C32H45NO13/c1-13(35)33-22-24(37)23(36)20(12-34)44-30(22)45-21-8-7-19-18-5-3-14-11-15(4-6-16(14)17(18)9-10-32(19,21)2)43-31-27(40)25(38)26(39)28(46-31)29(41)42/h4,6,11,17-28,30-31,34,36-40H,3,5,7-10,12H2,1-2H3,(H,33,35)(H,41,42)/t17u,18u,19u,20-,21-,22-,23-,24-,25+,26+,27-,28+,30+,31-,32u/m1/s1/f/h33,41H
InChIKey: InChIKey=BHYDXVJSMVVTCR-KMEMDNJODP
SMILES: CC(=O)NC1C(C(C(OC1OC2CCC3C2(CCC4C3CCC5=C4C=CC(=C5)OC6C(C(C(C(O6)C(=O)O)O)O)O)C)CO)O)O
Names:
C04806
(2S,3S,4S,5R,6S)-6-[[(17R)-17-[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxy-oxane-2-carboxylic acid
17alpha-(N-Acetyl-D-glucosaminyl)-estradiol 3-D-glucuronoside
Registries:
PubChem CID 440489
PubChem ID 7368
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|