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cimicifoetiside A

Properties

Image

Occurences in reactions

MNX_ID

MNXM46780

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₃₇H₅₈O₁₀

charge

mass

662.403

reference

chebi:37779

InChIKey

IGLQSEIGKREACI-VYWUFNEXSA-N

InChI

InChI=1S/C37H58O10/c1-18-15-21-28(32(5,6)42)47-37(46-21)27(18)33(7)13-14-36-17-35(36)12-11-24(45-29-26(44-19(2)38)25(40)20(39)16-43-29)31(3,4)22(35)9-10-23(36)34(33,8)30(37)41/h18,20-30,39-42H,9-17H2,1-8H3/t18-,20+,21-,22+,23+,24+,25+,26-,27-,28+,29+,30-,33-,34-,35-,36+,37+/m1/s1

SMILES

CC(=O)O[C@H]1[C@H](O[C@H]2CC[C@]34C[C@]35CC[C@]3(C)[C@H]6[C@H](C)C[C@H]7O[C@@]6(O[C@@H]7C(C)(C)O)[C@H](O)[C@@]3(C)[C@@H]5CC[C@H]4C2(C)C)OC[C@H](O)[C@@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:37779 chebi:37779	cimicifoetiside A (23R,24S)-15alpha,25-dihydroxy-16beta,23:16alpha,24-diepoxy-9beta,19-cyclolanostan-3beta-yl 2-O-acetyl-alpha-L-arabinopyranoside cimigenol 3-O-(2-O-acetyl-alpha-L-arabinopyranoside)
lipidmaps:LMST01100006 lipidmapsM:LMST01100006	cimicifoetiside A 15alpha,25-dihydroxy-16beta,23R:16alpha,24S-diepoxy-9beta,19-cyclolanostan-3beta-yl 2-O-acetyl-alpha-L-arabinopyranoside cimigenol 3-O-(2-O-acetyl-alpha-L-arabinopyranoside)