ID: 104455
SMILES:C1(C(C)(C)OO)CCC(C)=CC1c1c(O)cc(CCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -15.519
InChIKey:KIXZNEPIYITTHO-UHFFFAOYSA-N
ID: 104456
SMILES:c1c(OC)c(CCC)c(O)c(O)c1C1C=C(C)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -13.899
InChIKey:YANAWVKXDCLPRJ-UHFFFAOYSA-N
ID: 104457
SMILES:O(Cc1c(O)c(CC=C(C)C)c(O)c(C2C=C(C)CCC2C(C)=C)c1O)C1OC(CO)C(O)C(O)C1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 520.619
CB1 binding score: -15.535
InChIKey:IRZAUXHIFPFNRJ-UHFFFAOYSA-N
ID: 104458
SMILES:c1c(O)c2c(cc1CCCCC)OC(C)(C)c1ccc(C)cc1-2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 104459
SMILES:c1cc(CCCCC)cc2c1c1c(cc2)OC(C)(C)C2C(=C(C)CC2)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.53
CB1 binding score: -14.69
InChIKey:AUYAKWBKTDTPDS-UHFFFAOYSA-N
ID: 104460
SMILES:C1(CO)(O)CCC(C(C)C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.472
CB1 binding score: -15.374
InChIKey:RPVFCYVRPRCYIK-UHFFFAOYSA-N
ID: 104461
SMILES:CC1(C)C2CCC(CO)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 104462
SMILES:C1C(CCC=C(CO)C)(C)Oc2c(c(O)cc(CCCCC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.346
InChIKey:POPBLMRNLSTLOC-UHFFFAOYSA-N
ID: 104463
SMILES:c1(C(=O)C(C)C)cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -18.304
InChIKey:MLCYRUTXUZZKHD-UHFFFAOYSA-N
ID: 104464
SMILES:C1C(OC2OC(CO)C(O)C(O)C2O)(C)CC2=C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.592
CB1 binding score: -13.283
InChIKey:MUWUASOBUHSYFO-UHFFFAOYSA-N
ID: 104465
SMILES:Oc1c(C2C(C(C)=C)CCC(C)=C2)c(O)c(C(=O)OC)c(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -16.227
InChIKey:YPVFNGMEZXFJKG-UHFFFAOYSA-N
ID: 104466
SMILES:C1(C)(C)C2CCC(CO)(CC2c2c(O)cc(CCCCC)cc2O1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -19
InChIKey:AWUDMACGDPCMRJ-UHFFFAOYSA-N
ID: 104467
SMILES:C(c1c(O)c(O)c2c(c1)CCC(C(C)=C)C21CC(C(O)(C)C)OC1=O)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -13.576
InChIKey:VHZFZRVVIQQMFN-UHFFFAOYSA-N
ID: 104468
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 104469
SMILES:C12=CC(CC(=CCc3c(O)cc(C)cc3O)C)C(C(C)=CC1=O)OC(C=C(C)C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.538
CB1 binding score: -15.048
InChIKey:IMSFEXRQMZAFHJ-UHFFFAOYSA-N
ID: 104470
SMILES:CC(C1C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1)C=CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -17.328
InChIKey:BOXTVSGKMURSGG-UHFFFAOYSA-N
ID: 104471
SMILES:c1(O)c(C2C(C(C)=C)CCC(C)=C2)c(C)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.798
InChIKey:KDZOUSULXZNDJH-UHFFFAOYSA-N
ID: 104472
SMILES:c1c(CCCC(C)(O)C)cc2c(c1)C1C(C(O)(C)C)CCC1(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -14.592
InChIKey:VGFQWEVXGMLJIX-UHFFFAOYSA-N
ID: 104473
SMILES:OC1C(CO)OC(Oc2cc(CCCCC)cc(O)c2C2(C)C3(CCl)OC3CCC2C)C(O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 515.043
CB1 binding score: -14.016
InChIKey:PKYPOMHOXUDMAN-UHFFFAOYSA-N
ID: 104474
SMILES:CC(C)=CCCC1(C)C=Cc2c(cc(C(=O)O)c(CCCCC)c2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.502
InChIKey:JVSZCPXOYYXJTQ-UHFFFAOYSA-N
ID: 104475
SMILES:Oc1cc(CC=C(C)C)c(O)cc1CC=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.051
InChIKey:TXLIVWXFPYVBTA-UHFFFAOYSA-N