ID: 88621
SMILES:C(CCCC)c1cc2c(c(O)c1)C1CC(C)(CCC1C(C)=C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N
ID: 88622
SMILES:O1c2c(C(OC)=O)c(CCCCC)cc(O)c2C2C(C1(C)C)CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.978
InChIKey:LKLZAPSGDVLPGH-UHFFFAOYSA-N
ID: 88623
SMILES:Oc1c(O)c2c(c(O)c1CC(CC=C(C)C)C(C)=C)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -14.826
InChIKey:YCQVLNHGRFMOCD-UHFFFAOYSA-N
ID: 88624
SMILES:C1(CCC(C)C)C(C)(C)Oc2c(CCC)cc(OC)c(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.446
CB1 binding score: -15.142
InChIKey:ZGPQMEOKQOBGBO-UHFFFAOYSA-N
ID: 88625
SMILES:C1(C)=CC2C(CC1=O)C(C)(C)Oc1cc(CCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -18.142
InChIKey:SZPHYTJHUNYTBP-UHFFFAOYSA-N
ID: 88626
SMILES:OC1C(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C(O)=O)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -16.513
InChIKey:LUBNYEDOFSASPB-UHFFFAOYSA-N
ID: 88627
SMILES:C(C(C(C)(C)O)O)c1c(CO)c(CCCCC)cc2c1OC(C)(C)C1CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.617
CB1 binding score: -13.032
InChIKey:UVCUJOHIXDAXDF-UHFFFAOYSA-N
ID: 88628
SMILES:CC(C)C1=CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.875
InChIKey:MABLLFKQVKWWPG-UHFFFAOYSA-N
ID: 88629
SMILES:C(=O)(C(=O)O)C1(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C(=O)OC)C3Cc4c(C(C)C)oc(=O)cc4C(C1)C23C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 592.685
CB1 binding score: -14.619
InChIKey:WMGKQCBKUQDTMD-UHFFFAOYSA-N
ID: 88630
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C3C(C)(O3)CCC1C(C)(O)CCC(C(C)(O)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.601
CB1 binding score: -16.251
InChIKey:SADNXPTZVHQJFR-UHFFFAOYSA-N
ID: 88631
SMILES:C1(O)C(C)(C)Oc2c(c(O)cc(CCCCC)c2)C1C=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -16.183
InChIKey:DFDHKXHNAHWYAA-UHFFFAOYSA-N
ID: 88632
SMILES:CCCCCc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.302
InChIKey:IPGGELGANIXRSX-UHFFFAOYSA-N
ID: 88633
SMILES:C12C(C)(C(O)CC(O)C1(C)CO)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.482
CB1 binding score: -13.68
InChIKey:SPBWMJHTRNOXBU-UHFFFAOYSA-N
ID: 88634
SMILES:CC(C)C(Cc1c(O)c(C2C=C(C)CCC2C(C)=C)c(O)cc1O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.492
InChIKey:CEIWKXBOACNLKA-UHFFFAOYSA-N
ID: 88635
SMILES:c1(CCC)cc(O)c(C2C(C(C)=C)CCC(C)=C2)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.416
CB1 binding score: -20.718
InChIKey:RGRVRWPXYHVOQC-UHFFFAOYSA-N
ID: 88636
SMILES:c12c(OC)cc(CCCCC)cc1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 88637
SMILES:c1c(O)ccc2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -18.541
InChIKey:DXDRGIVLXHOGHC-UHFFFAOYSA-N
ID: 88638
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)-c2c(O)cc(CCCCC)cc21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -17.512
InChIKey:MHSYVZRTKSNMPN-UHFFFAOYSA-N
ID: 88639
SMILES:C(C)(=CCCC(=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 88640
SMILES:C(=C)(C1CCC(C)=CC1c1c(OC(=O)C)cc(O)cc1CC(O)(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.125
InChIKey:LVYUJDRYDOAIDL-UHFFFAOYSA-N
ID: 88641
SMILES:c12c(cc(CCCCCCl)cc1OC)OC(C)(C)C1C2C=C(C(OC)=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.95
CB1 binding score: -15.217
InChIKey:HCTFSAIRVJACAU-UHFFFAOYSA-N