ID: 85471
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(COC3C(O)C(O)C(O)C(CO)O3)=CC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.637
CB1 binding score: -15.298
InChIKey:NQGCPFXUCHGZSZ-UHFFFAOYSA-N
ID: 85472
SMILES:C(Cc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -17.691
InChIKey:JUCOHRGEXRGBDB-UHFFFAOYSA-N
ID: 85473
SMILES:O=C1c2c(cc(CCCCC)cc2O)OC(C)(C)C2CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.678
InChIKey:YABJYMBYKNQWLC-UHFFFAOYSA-N
ID: 85474
SMILES:O1C2C1(C)C1C(c3c(cc(CCCCC)cc3O)O1)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.502
InChIKey:NTHKQSJCNRGIAN-UHFFFAOYSA-N
ID: 85475
SMILES:C(CCCC)c1cc(OC)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.823
InChIKey:GRLARWXSTOXAGR-UHFFFAOYSA-N
ID: 85476
SMILES:C12c3c(O)cc(CCCCC)cc3OC3(CCC(C(C)(O)COC(=O)C)O3)C1(C)C(C)CCC2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.637
CB1 binding score: -15.56
InChIKey:ZJXYIMHDSNWYMW-UHFFFAOYSA-N
ID: 85477
SMILES:C1(=O)Oc2cc(CCCCC)cc(O)c2C2C=C(C)CCC2C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.141
InChIKey:STNIUGDPECKSAQ-UHFFFAOYSA-N
ID: 85478
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 85479
SMILES:CC1=CC2c3c(cc(CCCCC)c(OC(=O)C)c3OC3(C)C(C)(C1)OCC=C(C)CC3)OC2(c1ccccc1)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 558.759
CB1 binding score: -16.217
InChIKey:BSXZYXSLNIXGTL-UHFFFAOYSA-N
ID: 85480
SMILES:C(=C)(C(c1cc(O)c(C2C(C(C)C)CCC(C)=C2)cc1)C=C(CCC=C(C)C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.654
CB1 binding score: -15.914
InChIKey:YVVBQGIQOCAMJR-UHFFFAOYSA-N
ID: 85481
SMILES:C(CCC)CCCCCCc1cc2c(c(O)c1C(=O)CC(C)C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.722
CB1 binding score: -16.076
InChIKey:YHDCLNSCURVLHK-UHFFFAOYSA-N
ID: 85482
SMILES:C1=CC(C(C)C)CCC12COc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -14.145
InChIKey:VMEDJGDDEWQRLO-UHFFFAOYSA-N
ID: 85483
SMILES:C(=C)(C1C(c2c(O)cc(CCCCCO)cc2OC)C=C(C)C(O)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.193
InChIKey:PYFBEQYNXQTOEZ-UHFFFAOYSA-N
ID: 85484
SMILES:C(CCC)c1ccc(O)c2c1OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -18.434
InChIKey:AAUHGTZHLYKXQV-UHFFFAOYSA-N
ID: 85485
SMILES:OC(=O)c1cc2c(cc1CCCCC)OC(C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -15.929
InChIKey:JTJURXRGMLGMNO-UHFFFAOYSA-N
ID: 85486
SMILES:CC1=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 85487
SMILES:C1(OC(=O)CCCCCCCCCC)C(C)COC2(C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 530.79
CB1 binding score: -13.434
InChIKey:HJXVKYHDPDOPLF-UHFFFAOYSA-N
ID: 85488
SMILES:C12=CC(O)(CO)CCC1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -17.449
InChIKey:UCBXMUUUXKFDLM-UHFFFAOYSA-N
ID: 85489
SMILES:O(C(=O)C(C)=C)C1CC(C)(C)Oc2c(cc(CCCCC)cc2O)C1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -13.327
InChIKey:KVBQQDGCTSXJQO-UHFFFAOYSA-N
ID: 85490
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(O)(C)C)CCC1(C)C(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.566
CB1 binding score: -15.183
InChIKey:YPFCRUAFHVOVPU-UHFFFAOYSA-N
ID: 85491
SMILES:C(CCc1cc(O)c(C#C)c(O)c1CCCCC)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -13.36
InChIKey:KYCGDTQZXCERNA-UHFFFAOYSA-N