ID: 32635
SMILES:C(CCC(=CCCC1(C)Oc2c(c3c(cc(CCCCC)cc3O)OC2(C)C)C=C1)C)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.69
CB1 binding score: -15.475
InChIKey:YJTGKAHPEHNLMF-UHFFFAOYSA-N
ID: 32636
SMILES:OC1C2=C(C(O)C(C)(CO)C2)C2(Oc3c4c(cc(CCCCC)c3)OC3(C)CC4C(C(C)(C)O)CC3C)C(=O)C(=O)C2=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 608.772
CB1 binding score: -14.624
InChIKey:UPOFZOXZLJJCDP-UHFFFAOYSA-N
ID: 32637
SMILES:CC1C2=C(CC(CO)(C)C2)C2(c3c(cc(CCCCC)cc3O)OC2)C(=O)C1C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: -16.938
InChIKey:GSBVTPJIMQVVLE-UHFFFAOYSA-N
ID: 32638
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 32639
SMILES:C1CC(=C)C(O)CC1C(C)(C)c1c(O)cc(O)c2c1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -12.975
InChIKey:JKMSHWOFRFZQAX-UHFFFAOYSA-N
ID: 32640
SMILES:C1C2(C(O)C(C(C)=O)C(C)(C)C2)CC(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -16.157
InChIKey:BIMAVRRRJSUBAP-UHFFFAOYSA-N
ID: 32641
SMILES:C(C)CCCc1c(-c2c(O)cc(CCCCC)cc2O)c2c3c4c1OC(C)(C)C1CCC(C)(O3)C4CC1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 520.71
CB1 binding score: -12.959
InChIKey:VZTKFLWPPLJKTO-UHFFFAOYSA-N
ID: 32642
SMILES:CC(C)(O)C1CCC(CO)OC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.471
CB1 binding score: -14.256
InChIKey:OSRNULLYDNVJJL-UHFFFAOYSA-N
ID: 32643
SMILES:CC(C)(O)c1ccc(C2OC(CCC3(C)OC3(C)C)CC2)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -15.187
InChIKey:APQSYHMAEDTHGP-UHFFFAOYSA-N
ID: 32644
SMILES:c1c2c(c(CCCCC)cc1O)OC(C)(C)C1=C2C2=C[CH]C(C(C)C)C2(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 393.591
CB1 binding score: -14.808
InChIKey:BQVZPXBGQIFVQQ-UHFFFAOYSA-N
ID: 32645
SMILES:C(CCc1ccc(C2C(C(C)C)CCC(C)=C2)c(O)c1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.54
CB1 binding score: -17.155
InChIKey:QQLLKQTYSNYRRU-UHFFFAOYSA-N
ID: 32646
SMILES:C(CCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 32647
SMILES:COc1c(CC=C(C)CC(CC(C)=C)O)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -14.673
InChIKey:DEEWYVKSJMMIRE-UHFFFAOYSA-N
ID: 32648
SMILES:CC(=C1C(c2c(O)cc(C(O)CCCC)cc2O)C=C(C)CC1)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.367
InChIKey:VLANOOCJPKARPG-UHFFFAOYSA-N
ID: 32649
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(C(O)(C)C)CCC(C)(C=C1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -13.439
InChIKey:RAIWWUWDQYFJQM-UHFFFAOYSA-N
ID: 32650
SMILES:C1CCC(CCC=C(C)C)(C)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.902
InChIKey:QONQJLRREXQNPH-UHFFFAOYSA-N
ID: 32651
SMILES:C1(C)=CCC(C(C)(O)C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.444
InChIKey:QIWLDRCTCOCQKX-UHFFFAOYSA-N
ID: 32652
SMILES:CC1=CCC(C)(C)CC2c3c(cc(CCCCC)cc3O2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -14.962
InChIKey:KTWNTISANATBQZ-UHFFFAOYSA-N
ID: 32653
SMILES:c1(CCCC)c(O)cc2c(c1O)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.082
InChIKey:PBMDVMXHDJRQRK-UHFFFAOYSA-N
ID: 32654
SMILES:C1(O)C(C)(C)C2(CO)CCC(C)=CC2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -16.548
InChIKey:MNMWCPWYPWESOW-UHFFFAOYSA-N
ID: 32655
SMILES:c12c(O)c(O)c(CCCCC)cc1OC(C)(C)C1C2CC(O)(C)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -18.396
InChIKey:FMSRAZMIKZBRQO-UHFFFAOYSA-N