ID: 80074
SMILES:C1CC2(C)Oc3c(c(O)cc(CCCCC)c3)C3C2C(C(O)(C)C)CCC3(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -13.677
InChIKey:NYLWBVCNUCZYRF-UHFFFAOYSA-N
ID: 80075
SMILES:CC1C(c2cc(CCCCC)ccc2O)C(C(=C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.459
CB1 binding score: -13.616
InChIKey:XZPJTRWTIGXGSH-UHFFFAOYSA-N
ID: 80076
SMILES:C1(C)(CCC=C(C)C)C(O)Cc2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.002
InChIKey:ITDDKOGKAGSKEJ-UHFFFAOYSA-N
ID: 80077
SMILES:O=C(c1c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CC2=C(C)CCCC2c2ccc(O)c(O)c21)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.639
CB1 binding score: -16.303
InChIKey:SXDILHNBFKXWOI-UHFFFAOYSA-N
ID: 80078
SMILES:C1=C(C(=O)OC)CCC2C(C)(C1)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.745
InChIKey:DCVIVWFKXCKIJR-UHFFFAOYSA-N
ID: 80079
SMILES:C(CCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -17.892
InChIKey:YCSIDAUWCFLSQK-UHFFFAOYSA-N
ID: 80080
SMILES:c1(C)cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.619
InChIKey:MMZAEMNNHWYQKW-UHFFFAOYSA-N
ID: 80081
SMILES:C12C(C)=CCC1C(C)(C)Oc1c2ccc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 230.307
CB1 binding score: -16.425
InChIKey:MGIPSXIWLIEMNN-UHFFFAOYSA-N
ID: 80082
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(OCc3ccc(OC)cc3)c2C=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.501
CB1 binding score: -13.614
InChIKey:SRMXGKXHHPDRKF-UHFFFAOYSA-N
ID: 80083
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 80084
SMILES:c1(O)cc(C)cc2c1C(C)(C)C1(CCC(C)(C)O1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -17.1
InChIKey:IFECCZWVFBPRFH-UHFFFAOYSA-N
ID: 80085
SMILES:c12c(c(O)cc(CCCCC)c1)-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 80086
SMILES:C(c1cc(C2C=C(C)CCC2C(=C)C)c(O)c(C=O)c1O)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -16.827
InChIKey:LKZFGNXPIMGPEV-UHFFFAOYSA-N
ID: 80087
SMILES:C(CCCc1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1C(O)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 80088
SMILES:C(c1c(O)cc(CCCCC)c(C(=O)CCCC)c1O)C=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.929
InChIKey:TZBDUWZUVGBCOW-UHFFFAOYSA-N
ID: 80089
SMILES:c1(CCCCC)c2c(c3c(c1OC)OC(C)(C)C1CC1C(C)(C)O3)C=CC(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -16.92
InChIKey:VZSFHOOJYXRQKK-UHFFFAOYSA-N
ID: 80090
SMILES:Cc1c2c(cc(CCCCC)c1)CC(C(C)(O)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.421
CB1 binding score: -15.433
InChIKey:CTDJTOKPVCDVKS-UHFFFAOYSA-N
ID: 80091
SMILES:C1(C)(C)C2CCC(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 80092
SMILES:c1(O)cc(COC(C)=O)cc(O)c1CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -18.471
InChIKey:GXTVPSQVRXITHS-UHFFFAOYSA-N
ID: 80093
SMILES:C1CC(C)(C)C2C(c3c(O)cc(CCCCC)cc31)OC=C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -14.41
InChIKey:MMWHWUHJJZZVQE-UHFFFAOYSA-N
ID: 80094
SMILES:C1C2C(C)(C)Oc3c(c(OC)cc(OC)c3C3OC(C)(C)C(O)C3)C2CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -14.662
InChIKey:GZHGLPDDCZEPOU-UHFFFAOYSA-N