CAS: 20137-37-5 - Rotundic acid
Fórmula:C30H48O5
InChI:InChI=1S/C30H48O5/c1-18-9-14-30(24(33)34)16-15-27(4)19(23(30)29(18,6)35)7-8-21-25(2)12-11-22(32)26(3,17-31)20(25)10-13-28(21,27)5/h7,18,20-23,31-32,35H,8-17H2,1-6H3,(H,33,34)/t18-,20-,21-,22+,23-,25+,26+,27-,28-,29-,30+/m1/s1
Chave InChI:InChIKey=YLHQFGOOMKJFLP-LTFXOGOQSA-N
SMILES:O=C(O)C12CCC(C)C(O)(C)C2C3=CCC4C5(C)CCC(O)C(C)(CO)C5CCC4(C)C3(C)CC1
- Sinónimos:
- Urs-12-en-28-oic acid, 3β,19,23-trihydroxy-
- 3β,19α,23-Trihydroxyurs-12-en-28-oic acid
- (3β,4α)-3,19,23-Trihydroxyurs-12-en-28-oic acid
- Urs-12-en-28-oic acid, 3,19,23-trihydroxy-, (3β,4α)-
- Rotundic acid