ID: 44479
SMILES:c1c(CCCCC)cc2c(c1O)C=CC(CCC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 44480
SMILES:CC1=CCCC(C)C1Oc1c(O)c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -12.254
InChIKey:IVDOFPLCSPGZFT-UHFFFAOYSA-N
ID: 44481
SMILES:CC(=CC1(C(=O)OC)C(C)(C)c2c(cc(CCCCC)cc2O)O1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -14.467
InChIKey:YPZQTVVSWXXULI-UHFFFAOYSA-N
ID: 44482
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1c2c(OC)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 44483
SMILES:c12c(c(CCCCC)cc(O)c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.291
InChIKey:FFUWPSOUQRLGHT-UHFFFAOYSA-N
ID: 44484
SMILES:C(CC)CCc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 44485
SMILES:C(C)(=CCc1c(O)c(C=O)c(CCCCC)cc1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 344.495
CB1 binding score: -19.069
InChIKey:ROXSKQXJGMFFHX-UHFFFAOYSA-N
ID: 44486
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CC=C(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.723
InChIKey:WKFVIMFNRJVSJG-UHFFFAOYSA-N
ID: 44487
SMILES:c1(O)c(CC=C(C)C)c(O)nc2c1c1c(cc2C)OC(C)(C)C2C1CC(C)C1=CCC(C)C1C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 461.646
CB1 binding score: -16.288
InChIKey:AUQTYJPCHLNHLF-UHFFFAOYSA-N
ID: 44488
SMILES:C12(C)C(=O)OC3c4c(cc(CCCCC)cc4O)C(O)C1C(OC(C)=O)CC23
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -12.813
InChIKey:UGHAWEBLLQJDCE-UHFFFAOYSA-N
ID: 44489
SMILES:C(Cc1c2c(c(O)cc1O)C1CC(C)=CCC1C(C)(C)O2)(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -13.472
InChIKey:RNZWDNTZSGBBKY-UHFFFAOYSA-N
ID: 44490
SMILES:CCCCCc1c(O)c2c(c3c1OCC3C)CC(C)=CCC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -14.676
InChIKey:FXOKGCBIJMDWPZ-UHFFFAOYSA-N
ID: 44491
SMILES:Oc1cc(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 44492
SMILES:C(OC1C(C)(C)Oc2c(c(O)cc(CCCCC)c2)C1C=C(C)C)(=O)C(C)=CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -15.929
InChIKey:MLKBWKYHCOOAEO-UHFFFAOYSA-N
ID: 44493
SMILES:CC1(C)C2=C(c3c(cc(CCCCC)cc3O)O1)CC(C)C(O)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.21
InChIKey:NHZCPNMEUIZUEE-UHFFFAOYSA-N
ID: 44494
SMILES:CC(CC(c1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C(O)=O)CC1)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -16.534
InChIKey:CBZNCUSDLDXHCJ-UHFFFAOYSA-N
ID: 44495
SMILES:C(C1C(C)(C)Oc2cc(CCCc3ccccc3)c(O)c(CCCCC)c21)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.637
CB1 binding score: -13.64
InChIKey:VXTKVSAMZAEPII-UHFFFAOYSA-N
ID: 44496
SMILES:c1(O)ccc(CC)cc1C(C)(Cc1cc2c(cc1O)C(=O)C(C)(C)C1C(C(C)C)CC=C(C)C1C2)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 502.739
CB1 binding score: -15.434
InChIKey:BKEATGAOEXWUFM-UHFFFAOYSA-N
ID: 44497
SMILES:c1(O)c2c(cc(CCCCC)c1)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: 44498
SMILES:C1C(C(C)C)C(c2c(OC)ccc(CCCCC)c2)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.513
CB1 binding score: -17.104
InChIKey:KCNKFEKQAPWBKX-UHFFFAOYSA-N
ID: 44499
SMILES:c12c(CCCCC)cc(O)cc1OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.043
InChIKey:XZKFXCQNHZRBJK-UHFFFAOYSA-N