20-hydroxyecdysone
Chemical Formula:
C27H44O7
Molecular Weight:
480.64 Daltons
Monoisotopic Mass:
480.3087037671 Daltons
SMILES:
CC(O)(C)CCC(O)C(O)(C)[CH]1(CCC3(O)(C(C)1CC[CH]2(C4(C)(CC(C(O)C[CH](C(=O)C=C23)4)O))))
InChI:
1S/C27H44O7/c1-23(2,32)9-8-22(31)26(5,33)21-7-11-27(34)16-12-18(28)17-13-19(29)20(30)14-24(17,3)15(16)6-10-25(21,27)4/h12,15,17,19-22,29-34H,6-11,13-14H2,1-5H3/t15-,17-,19+,20-,21-,22+,24+,25+,26?,27+/m0/s1
InChIKey:
Databases
MetaCyc:
CPD-276
ChEBI:
16587
PubChem (CID):
21362
HMDB:
HMDB30180
ChemSpider:
388826
KEGG:
C02633
CAS:
5289-74-7
Seed:
cpd01712
MetaNetX:
MNXM2776