ID: 102754
SMILES:C(CCCC)Cc1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 358.522
CB1 binding score: -16.913
InChIKey:AYWVKGJYCBPCNM-UHFFFAOYSA-N
ID: 102755
SMILES:Oc1cc(CCC(O)=O)c(C)c2c1-c1c(cc(C)cc1OC)CC2CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.511
CB1 binding score: -15.67
InChIKey:XOOHRSJFVIIIHQ-UHFFFAOYSA-N
ID: 102756
SMILES:C(C)(=CCCC1(C)C2c3c(c(CCCCC)cc(O)c3C(C(C)=C)C2)CC1=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.599
CB1 binding score: -15.321
InChIKey:QZEFGYHWQUJFFT-UHFFFAOYSA-N
ID: 102757
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C=C(C)COC2(OC)CC1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.302
InChIKey:YVNOZLRRCZKQAG-UHFFFAOYSA-N
ID: 102758
SMILES:C(CC)Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C(=O)O)=CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.109
InChIKey:RMRVJKSWTLSKET-UHFFFAOYSA-N
ID: 102759
SMILES:OC12CC(=C)CCC1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.56
InChIKey:UQALAHMDMYSYFE-UHFFFAOYSA-N
ID: 102760
SMILES:Oc1c(CC=C(CCC2C(C)=CCC(O)C2(C)C)C)c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -19.175
InChIKey:RNJONNJXCMJVBX-UHFFFAOYSA-N
ID: 102761
SMILES:O=C(c1c(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)cc1)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.67
InChIKey:VBBIZTWEJRLSBM-UHFFFAOYSA-N
ID: 102762
SMILES:C(C)CCCCCCc1cc(OC)c(C2C=C(C)CC(c3c(O)ccc(CCCCC)c3)C2C(C)(O)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 550.824
CB1 binding score: -14.232
InChIKey:MCNIXCCXCLVWSA-UHFFFAOYSA-N
ID: 102763
SMILES:CC(=CCCC1(C)C=Cc2c(c(O)cc(CCC)c2)O1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.747
InChIKey:XMNROVQWKXIDRH-UHFFFAOYSA-N
ID: 102764
SMILES:C1(C(C)(O)C)CC(=O)C2(C)OC2Cc2c(c(CCCCC)cc(O)c2)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -12.977
InChIKey:JPWLFNHHFPDBML-UHFFFAOYSA-N
ID: 102765
SMILES:Oc1cc(CCC)cc2c1C1C(CC=C(C)C1)C(C)CO2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -15.172
InChIKey:MEWGUHPQZVSTHY-UHFFFAOYSA-N
ID: 102766
SMILES:O1c2c(cc(CCCCC)cc2)C(C(C)(OC)C)CCC1(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.473
CB1 binding score: -15.374
InChIKey:IGSRFLXPMUOCGE-UHFFFAOYSA-N
ID: 102767
SMILES:C1C(C)(C)Oc2c(c(O)cc(CCC)c2)C1C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -17.518
InChIKey:WUNCHMZSBRXUOJ-UHFFFAOYSA-N
ID: 102768
SMILES:C=Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(CO)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -16.273
InChIKey:SOKDSTFLNOMNCX-UHFFFAOYSA-N
ID: 102769
SMILES:C(C)(C)(O)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.812
InChIKey:FTDORWGKHUOHKJ-UHFFFAOYSA-N
ID: 102770
SMILES:C12CC(C)(C)CC1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.02
InChIKey:IXCMIZVDMJHBOT-UHFFFAOYSA-N
ID: 102771
SMILES:CC1(C)Oc2cc(CCCCC)cc(OC)c2C2C1C(O)C(C)C1(O)C2C(=O)CC(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -14.678
InChIKey:UXUVORPXLBXVKZ-UHFFFAOYSA-N
ID: 102772
SMILES:C(C1(C)C2(C)c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -15.519
InChIKey:NJLOOPRWQFBAMK-UHFFFAOYSA-N
ID: 102773
SMILES:C(=Cc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(CO)CC1)CCC(=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -12.31
InChIKey:GVACPXMITNRQRN-UHFFFAOYSA-N
ID: 102774
SMILES:c1(CCCCC)cc2c(c(O)c1)C1CC(C(=O)OC)(C2)C(C)CO1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -14.524
InChIKey:UYAXYVUQJGHORE-UHFFFAOYSA-N