HEPTACARBOXYLPORPHYRIN I HEPTAMETHYL ESTER

CAS No.
885267-27-6
CCD No.
CCD00673764
Formula
C46 H52 N4 O14
MolWeight
884.931

Basic Information

Product Name: HEPTACARBOXYLPORPHYRIN I HEPTAMETHYL ESTER
CAS: 885267-27-6
English Synonyms: HEPTACARBOXYLPORPHYRIN I HEPTAMETHYL ESTER
MDL Number.: MFCD08669588
H bond acceptor: 18
H bond donor: 2
Smile: Cc1/c/2c/c3n/c(c\c4c(c(c([nH]4)/cc/5\nc(/cc(/c1CCC(=O)OC)\[nH]2)C(=C5CCC(=O)OC)CC(=O)OC)CC(=O)OC)CCC(=O)OC)/C(=C3CCC(=O)OC)CC(=O)OC
InChi: InChI=1S/C46H52N4O14/c1-24-25(9-13-40(51)58-2)33-21-37-30(18-45(56)63-7)27(11-15-42(53)60-4)35(49-37)23-39-31(19-46(57)64-8)28(12-16-43(54)61-5)36(50-39)22-38-29(17-44(55)62-6)26(10-14-41(52)59-3)34(48-38)20-32(24)47-33/h20-23,47,50H,9-19H2,1-8H3/b32-20-,33-21-,34-20-,35-23-,36-22-,37-21-,38-22-,39-23-
InChiKey: InChIKey=HAJGURJBJZZUTJ-IHQQFAAOSA-N

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