BGC > Produktsuche > Jatrophane 3 | 210108-87-5

Molecular Formula: C43H53NO14

Description:
Jatrophane 3 can be found in the branches of Jatropha carcas L.

• Molecular Weight:807.9
• Purity:>98%

Molecular Formula:
C43H53NO14
Canonical SMILES:
CC1C=CC(C(C(C(C(=C)C(C2C(C(CC2(C1OC(=O)C)O)(C)OC(=O)C)OC(=O)C3=CC=CC=C3)OC(=O)C)OC(=O)C(C)C)O)OC(=O)C4=CN=CC=C4)(C)C
InChI:
InChI=1S/C43H53NO14/c1-23(2)38(49)55-34-25(4)33(53-26(5)45)31-36(56-39(50)29-15-12-11-13-16-29)42(10,58-28(7)47)22-43(31,52)35(54-27(6)46)24(3)18-19-41(8,9)37(32(34)48)57-40(51)30-17-14-20-44-21-30/h11-21,23-24,31-37,48,52H,4,22H2,1-3,5-10H3/b19-18-/t24-,31-,32+,33-,34-,35-,36+,37+,42+,43+/m0/s1
InChIKey:
HCOFSOQJSKXVMH-QBPFDXHJSA-N
Appearance:
Cryst.
Synonyms:
2,5,14-Triacetoxy-3-benzoyloxy-8,15-dihydroxy-7-isobutyroyloxy-9-nicotinoyloxyjatropha-6(17),11E-diene