ID: 128038
SMILES:c1(CCCCC)cc2c(c(O)c1)C1CC(C)(O2)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N
ID: 128039
SMILES:C(COC)Cc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.76
InChIKey:WNZILWMNYRSNLL-UHFFFAOYSA-N
ID: 128040
SMILES:C(CCC=C(C)C)(C)=CCc1cc(OC)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.513
CB1 binding score: -16.748
InChIKey:LQVLQQKEZXMZJP-UHFFFAOYSA-N
ID: 128041
SMILES:c1(C(O)=O)c2c(cc(CCCCC)c1)OC(C)(C)C1=C3C2C(C(C)C3)C(O)CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -14.539
InChIKey:CLUTZPZCEVPRSW-UHFFFAOYSA-N
ID: 128042
SMILES:Clc1c(O)c(Cl)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.224
CB1 binding score: -13.64
InChIKey:UNSLFXNTENDNOQ-UHFFFAOYSA-N
ID: 128043
SMILES:C1(C)=CC2c3c(O)cc(C)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 128044
SMILES:CC1(C)Oc2c(c(O)cc(CCCCCCC)c2)C2C=C(C(C)(O)C)C(=O)CC12O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -13.926
InChIKey:SUIZQDNNIZLGPK-UHFFFAOYSA-N
ID: 128045
SMILES:CC1(C)C(CCC(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2=O)C(=C)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.679
CB1 binding score: -15.503
InChIKey:OFNNOYFIMBQYFA-UHFFFAOYSA-N
ID: 128046
SMILES:C1C2c3c(c(CC)c(C)c(O)c3CO)OC(C)(C)C2CC=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -14.239
InChIKey:WCKYSIUMKHKCJE-UHFFFAOYSA-N
ID: 128047
SMILES:c1(O)cc(C)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1CCC(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -16.603
InChIKey:HDWXEIDOTHGDRC-UHFFFAOYSA-N
ID: 128048
SMILES:C=C(C1CCC(CO)=CC1c1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -20.344
InChIKey:ZELUXPWDPVXUEI-UHFFFAOYSA-N
ID: 128049
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C=O)=CC21)C(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -15.929
InChIKey:DOAOOAATIHSDKT-UHFFFAOYSA-N
ID: 128050
SMILES:C(CCCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 128051
SMILES:Oc1c(C(OC)=O)c(CCCCC)c(C)c2c1OC(C)(C)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -15.554
InChIKey:OHQWYNKKKPMKEY-UHFFFAOYSA-N
ID: 128052
SMILES:C1(OC)(C)CCC(C(C)C)=C1C1Oc2cc(CCCCC)cc(O)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -14.133
InChIKey:IGSNFOHRPVLCFC-UHFFFAOYSA-N
ID: 128053
SMILES:C(CC)CCCCCc1cc2c(c(OC)c1)OC(C)(C)c1c-2cc(C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -13.89
InChIKey:QAAMIBCMAWPAKL-UHFFFAOYSA-N
ID: 128054
SMILES:O(c1c(C2C(C(C)=CCC=C(C)C)CCC(C)=C2)c(O)cc(C)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -17.197
InChIKey:WVLVEPBUDGVWTN-UHFFFAOYSA-N
ID: 128055
SMILES:C(CCc1ccc(O)c2c1OC(C)(C)C1CCC(C)=CC12)=CC(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.584
InChIKey:PXTPECVIVIKWPZ-UHFFFAOYSA-N
ID: 128056
SMILES:c1cc(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -17.687
InChIKey:FAILRRYKWGYKKV-UHFFFAOYSA-N
ID: 128057
SMILES:O(C(C)=O)C(=O)C1(O)C2(O)C(CCC1(C)O)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.528
CB1 binding score: -15.306
InChIKey:LRCZXMXDLWSDAL-UHFFFAOYSA-N
ID: 128058
SMILES:C1C(C)(C)Oc2cc(CCCCC)c(C(=O)O)c(O)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -19.505
InChIKey:CBTOHSIQSGOXJB-UHFFFAOYSA-N