Mohangamide A; 68-Demethyl, 72S,74-dihydro
AlkaPlorer ID: AK306866
Synonym: Mohangamide B
IUPAC Name: N-[6,28-bis(2-amino-2-oxoethyl)-12,34-dibenzyl-9,31-bis(1-hydroxyethyl)-3,25-bis(hydroxymethyl)-18-[(4-hydroxyphenyl)methyl]-40-[(4-hydroxyphenyl)methylidene]-19,41,44-trimethyl-15,37-bis(2-methylpropyl)-2,5,8,11,14,17,20,24,27,30,33,36,39,42-tetradecaoxo-43-[3-(2-pent-1-enylphenyl)prop-2-enoylamino]-1,23-dioxa-4,7,10,13,16,19,26,29,32,35,38,41-dodecazacyclotetratetracont-21-yl]-3-(3-pent-1-enyl-2,3-dihydro-1H-pyridin-4-ylidene)propanamide
Structure
SMILES: CCCC=CC1=CC=CC=C1C=CC(=O)NC1C(=O)N(C)C(=CC2=CC=C(O)C=C2)C(=O)NC(CC(C)C)C(=O)NC(CC2=CC=CC=C2)C(=O)NC(C(C)O)C(=O)NC(CC(N)=O)C(=O)NC(CO)C(=O)OCC(NC(=O)CC=C2C=CNCC2C=CCCC)C(=O)N(C)C(CC2=CC=C(O)C=C2)C(=O)NC(CC(C)C)C(=O)NC(CC2=CC=CC=C2)C(=O)NC(C(C)O)C(=O)NC(CC(N)=O)C(=O)NC(CO)C(=O)OC1C
InChI: InChI=1S/C106H139N17O26/c1-12-14-18-30-69-31-24-25-32-70(69)38-45-89(133)119-92-64(9)149-106(147)82(58-125)118-96(137)80(55-87(108)131)116-102(143)91(63(8)127)121-97(138)77(50-65-26-20-16-21-27-65)111-93(134)75(48-60(3)4)113-99(140)84(52-67-34-40-73(128)41-35-67)122(10)103(144)83(110-88(132)44-39-71-46-47-109-56-72(71)33-19-15-13-2)59-148-105(146)81(57-124)117-95(136)79(54-86(107)130)115-101(142)90(62(7)126)120-98(139)78(51-66-28-22-17-23-29-66)112-94(135)76(49-61(5)6)114-100(141)85(123(11)104(92)145)53-68-36-42-74(129)43-37-68/h16-43,45-47,53,60-64,72,75-84,90-92,109,124-129H,12-15,44,48-52,54-59H2,1-11H3,(H2,107,130)(H2,108,131)(H,110,132)(H,111,134)(H,112,135)(H,113,140)(H,114,141)(H,115,142)(H,116,143)(H,117,136)(H,118,137)(H,119,133)(H,120,139)(H,121,138)
InChIKey: HGMQSVYYZAWVRQ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces sp. SNM55 | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 2067.3710000000005
TPSA？: 662.01
MolLogP？: 0.2800999999999666
Number of H-Donors: 21
Number of H-Acceptors: 27
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|