ID: 76630
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.729
InChIKey:GIIVGKMZIUKMMN-UHFFFAOYSA-N
ID: 76631
SMILES:C(C)CCc1cc(O)cc2c1C1=C(C(C)(C)O2)CCC(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -14.986
InChIKey:PAOPTJQOJUUNAG-UHFFFAOYSA-N
ID: 76632
SMILES:CC1=CC(c2c(O)c(C(=O)O)c(CCCCC)cc2O)C(C)(C)C(O)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -12.722
InChIKey:GRISZFOHSTUGCS-UHFFFAOYSA-N
ID: 76633
SMILES:C(=C(C)C)Cc1c(O)cc(C)c(O)c1-c1cc(CC=C(C)CCC=C(C)C)c(O)c2c1OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 570.814
CB1 binding score: -13.576
InChIKey:FKPZVIFTVIFYCV-UHFFFAOYSA-N
ID: 76634
SMILES:C12C(C)(C)Oc3cc(CCCC)cc(O)c3C1C=C(C)C(=O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -17.144
InChIKey:QVOHZXGDRQEEJT-UHFFFAOYSA-N
ID: 76635
SMILES:O(C)C(C)(CC(CC(C)C)c1c(O)c2c(cc1O)OC(C)(C)c1ccc(C)cc12)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -15.066
InChIKey:XLXWAWFSDHDGPU-UHFFFAOYSA-N
ID: 76636
SMILES:C(C)(C(Oc1ccc2c(c1OC)OC(C)(C)C1C2C=C(C)CC1)Cc1ccccc1)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.549
CB1 binding score: -13.593
InChIKey:HEYPVSPWIDHLJP-UHFFFAOYSA-N
ID: 76637
SMILES:O=C(C)Oc1cc(CCCCC)cc2c1c1c(c(C(C(C)C)=O)c2O)OC(CCC=C(C)C)(C)C2CC1C(=O)C2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 562.703
CB1 binding score: -13.821
InChIKey:WGOFWZDUGYQVAK-UHFFFAOYSA-N
ID: 76638
SMILES:C1(COC(=O)c2ccccc2)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.559
CB1 binding score: -14.235
InChIKey:KDAXGQKTSLESMG-UHFFFAOYSA-N
ID: 76639
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1=CCC(C)=CC21)C=CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.464
CB1 binding score: -15.443
InChIKey:RYOMFWKPDHLISH-UHFFFAOYSA-N
ID: 76640
SMILES:C1CC2(C)Oc3c(c(O)cc(CCC)c3)C(C1O)C2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -16.038
InChIKey:NJASXXCBRSYKHS-UHFFFAOYSA-N
ID: 76641
SMILES:O(C)C(=O)c1ccc2c(c1CCCCC)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -17.43
InChIKey:KZTJKSNSURAWIV-UHFFFAOYSA-N
ID: 76642
SMILES:CC1=CC2c3c(cc(CCCCC)c(O)c3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.996
InChIKey:XXGMIHXASFDFSM-UHFFFAOYSA-N
ID: 76643
SMILES:C1=CC2C(CC1(C)C)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.661
InChIKey:QAGHXJPQNLLQOW-UHFFFAOYSA-N
ID: 76644
SMILES:Oc1c2c(cc(CCCCC)c1)C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.779
InChIKey:ZSDJPGLYWNHCIW-UHFFFAOYSA-N
ID: 76645
SMILES:c1(O)c(C=O)c(CCCCC)cc2c1C1C(CCC(CO)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.047
InChIKey:WXNDSMUOUTYDBH-UHFFFAOYSA-N
ID: 76646
SMILES:C1(=O)C2(Oc3c(c(O)cc(CCC)c3)C2C)C2CCC(C)=CCC(C)C(=C)C3C1(C)C3C2=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.603
CB1 binding score: -16.537
InChIKey:RCRIBKJAUWKQAX-UHFFFAOYSA-N
ID: 76647
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(=O)C(=C)C(C)(C2)C(C=O)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -16.506
InChIKey:QODLTPUFGWLTDX-UHFFFAOYSA-N
ID: 76648
SMILES:C1CC(C)(C)C(CCC2(C)Oc3c(c(O)cc(CCCCC)c3)C(=O)C2)=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.364
InChIKey:IZGGHIDXYNTQCQ-UHFFFAOYSA-N
ID: 76649
SMILES:C1(CC=C(C)C)Oc2c(c(O)cc(C)c2)C2CC(CO)=CCC21C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 328.452
CB1 binding score: -15.238
InChIKey:ODRUGZYXMKYATF-UHFFFAOYSA-N
ID: 76650
SMILES:C1(=O)C(C)CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.046
InChIKey:UECUNLJHUBNWSC-UHFFFAOYSA-N