ID: 99583
SMILES:C(C=C(C)C)CC(=CCc1c(-c2c(O)cccc2)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.669
CB1 binding score: -12.112
InChIKey:BUPSIEDRWWSLPY-UHFFFAOYSA-N
ID: 99584
SMILES:C(c1c(O)c2c(c(O)c1CCCCCCCCC)OC(C)(C)C1CCC(C)=CC12)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.657
CB1 binding score: -16.551
InChIKey:JIAMQAMYAKTQMR-UHFFFAOYSA-N
ID: 99585
SMILES:O(C)c1c(O)c(OC)cc2c1-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -16.393
InChIKey:AMVBOMCUQJQZNE-UHFFFAOYSA-N
ID: 99586
SMILES:C12CC(C)(Oc3c1c(O)cc(CCCCCC)c3)C1CC(C)(C(OC(C)=O)CCC1(O)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.639
CB1 binding score: -16.438
InChIKey:RBYHUIKHGUGMEZ-UHFFFAOYSA-N
ID: 99587
SMILES:CC1(C)Oc2c(c(O)cc(CCC)c2)C2C3OC3(C(C)(O)CCC=C(C)C)CCC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -11.814
InChIKey:CBTABVCRXXRTFK-UHFFFAOYSA-N
ID: 99588
SMILES:C(C)(=O)Oc1c(C(=O)C(CC(C)C)C2(C)C3CCC(C)=CC3C=C2C)c(O)c(C(=O)O)c(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 524.698
CB1 binding score: -16.918
InChIKey:AUMBMRSLMIGDAV-UHFFFAOYSA-N
ID: 99589
SMILES:C12c3c(cc(CCCCC)cc3O)OC(CO)(C)C1CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -17.551
InChIKey:JJJRELWSPWMRIG-UHFFFAOYSA-N
ID: 99590
SMILES:c1(CCCCC)cc(OC)c(CC=C(C)CCC=C(C)C)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -18.913
InChIKey:GDBWRAFIFHBEOL-UHFFFAOYSA-N
ID: 99591
SMILES:C(Cc1c(CCCCC)cc2c(c1O)C=CC(CCC=C(C)C)(C)O2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -16.097
InChIKey:TYVZIXPPFXHYMP-UHFFFAOYSA-N
ID: 99592
SMILES:Oc1c2c(cc(CCCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 99593
SMILES:C(CCC)Cc1cc(O)c(C2C(C(=C)C)CCC(C)=C2)C(O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.279
InChIKey:ALXZAZFUKBATBH-UHFFFAOYSA-N
ID: 99594
SMILES:C=C1C2C(C)(CCC1)Oc1c(c(O)cc(CCCCC)c1)C2O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.203
InChIKey:ZIEIFZKIQYTRGX-UHFFFAOYSA-N
ID: 99595
SMILES:c1c(OC)c(C(=O)C(CC)C)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.339
InChIKey:HHQCCIBFJXGSGF-UHFFFAOYSA-N
ID: 99596
SMILES:C1C(C)=CC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3O)C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -11.101
InChIKey:WPRBOYVDACRPMN-UHFFFAOYSA-N
ID: 99597
SMILES:O1c2c(c(C(=O)O)c(CCCCC)cc2O)C=CC1(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.636
InChIKey:VKFFKPSFOREJKS-UHFFFAOYSA-N
ID: 99598
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.306
InChIKey:QMKLZUAUVNXRCV-UHFFFAOYSA-N
ID: 99599
SMILES:C(C)CCCc1cc(O)c(C2C(C(C)C)CCC(C)=C2)c(O)c1OC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -18.366
InChIKey:ZXWKWKVEDVBJNA-UHFFFAOYSA-N
ID: 99600
SMILES:C(=O)(O)c1c(O)c2c(cc1CCCCC)OC(C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 308.374
CB1 binding score: -17.527
InChIKey:TXECNXSKSOHJBY-UHFFFAOYSA-N
ID: 99601
SMILES:C1CC(C)=CCCC2=CC(c3c(O)cc(CCCCC)cc3OC(C)(C)C12)OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -15.293
InChIKey:LWGXGXGVFKWKRS-UHFFFAOYSA-N
ID: 99602
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 99603
SMILES:CC1(C)Oc2cc(O)cc(CCCCC)c2C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.296
InChIKey:SBDHCUZETSWOAX-UHFFFAOYSA-N