Lupa-1,12,20(29)-trien-3-one, 30-hydroxy-
CAS Registry Number®
152369-65-8
CAS Name
Lupa-1,12,20(29)-trien-3-one, 30-hydroxy-Molecular Formula
C30H44O2Molecular Mass
436.67Cite this Page
Lupa-1,12,20(29)-trien-3-one, 30-hydroxy-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=152369-65-8 (retrieved ) (CAS RN: 152369-65-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C30H44O2/c1-19(18-31)20-10-13-27(4)16-17-29(6)21(25(20)27)8-9-23-28(5)14-12-24(32)26(2,3)22(28)11-15-30(23,29)7/h8,12,14,20,22-23,25,31H,1,9-11,13,15-18H2,2-7H3/t20-,22-,23+,25+,27+,28-,29+,30+/m0/s1
InChIKey
InChIKey=ZQIULKXWJGSFAC-QAVDLUDMSA-N
SMILES
C[C@]12C([C@@]3([C@@](C)(CC1)CC[C@H]3C(CO)=C)[H])=CC[C@]4([C@@]2(C)CC[C@@]5([C@]4(C)C=CC(=O)C5(C)C)[H])[H]
Canonical SMILES
O=C1C=CC2(C)C(CCC3(C)C2CC=C4C5C(C(=C)CO)CCC5(C)CCC43C)C1(C)C
Other Names for this Substance
- Lupa-1,12,20(29)-trien-3-one, 30-hydroxy-
- 9H-Cyclopenta[a]chrysene, lupa-1,12,20(29)-trien-3-one deriv.
- Manglupenone