ID: 86038
SMILES:c1(C(C)C)c(O)c(Oc2c(C)cc(O)c(C(CCC=C(COC(=O)C)C)C)c2C)c(O)c2c1OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 606.8
CB1 binding score: -14.349
InChIKey:WNSSGPJECDMRCU-UHFFFAOYSA-N
ID: 86039
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(=C)C)CCC(C)(C(O)C1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.792
InChIKey:PANCLMXRCWESGS-UHFFFAOYSA-N
ID: 86040
SMILES:Cc1c(C(=O)OC(C)(C)CC)c(O)c2c(c1)OC(C)(C)C1C2(O)C=C(OC)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.502
CB1 binding score: -14.239
InChIKey:NIXAORCKYSCTGU-UHFFFAOYSA-N
ID: 86041
SMILES:C1C(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 86042
SMILES:CC12Oc3c(c(O)cc(CCCCC)c3)C(O)C1C1(C)CCCC(C)(C)C1C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -15.856
InChIKey:VBYFZSXPYBJQHJ-UHFFFAOYSA-N
ID: 86043
SMILES:c12c(cc(C(=O)O)cc1CCCCC)OC(C)(C)C(CC=C(C)C)CC2C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -16.241
InChIKey:BUKKBLNOULOAIX-UHFFFAOYSA-N
ID: 86044
SMILES:O=C(O)CCCc1cc2c(c(O)c1)C1C(=O)C(C)(C)OC1(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: -16.06
InChIKey:PKMKXWPPZBXRIK-UHFFFAOYSA-N
ID: 86045
SMILES:C(CCCCCc1cc(O)c2c(c1)OC(C)(C)C1C2C(OC(C(C)C)=O)CC(C)=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -16.224
InChIKey:UCDQSKIXUQOASH-UHFFFAOYSA-N
ID: 86046
SMILES:c1(O)c2c(cc(C(=O)CC(CCCC(CC)C)C)c1OC)OC(C)(C)C1CC=C(C(=O)OC)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.649
CB1 binding score: -12.152
InChIKey:GGSFQZNOASEQQO-UHFFFAOYSA-N
ID: 86047
SMILES:c1(CCC=C(C)CCCC(C)C)cc(C(O)=O)c2c(c1)OC(C)(C)C1C2CC(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.641
CB1 binding score: -16.217
InChIKey:YWCMNQZPZSOADO-UHFFFAOYSA-N
ID: 86048
SMILES:c1(CCCCC)cc2c(c(O)c1)OC(C)(C)C1CC=C(C(=O)O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.232
InChIKey:VOSIUROXKQMZTJ-UHFFFAOYSA-N
ID: 86049
SMILES:c1(C(O)=O)ccc2c(c1)-c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.419
CB1 binding score: -18.687
InChIKey:RUDAUXBQLBAKOW-UHFFFAOYSA-N
ID: 86050
SMILES:C1C(C)=CC(c2ccc(CCCCC)cc2)C(C(=C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 86051
SMILES:c1c(CCCCC)cc2c(c1O)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.779
InChIKey:ZSDJPGLYWNHCIW-UHFFFAOYSA-N
ID: 86052
SMILES:CC(=CCCC1(C)C=Cc2c(cc(CCc3ccccc3)cc2O)O1)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.605
CB1 binding score: -17.061
InChIKey:XASJGHJOROYPQC-UHFFFAOYSA-N
ID: 86053
SMILES:O1C2(OC3C4(C(C3)c3c(cc(CCCCC)cc3O)OC4)C2)C(C(=C)C(=O)OC)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.498
CB1 binding score: -15.288
InChIKey:XVDGFMYJKPTCNB-UHFFFAOYSA-N
ID: 86054
SMILES:c1(CCCCCC)cc2c(c(O)c1)C1C(C(=C)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.354
InChIKey:LOTJAJIHOKJTOT-UHFFFAOYSA-N
ID: 86055
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1OC(C)(C)OC3C14C(C(C)CC4C=C(C)C(=O)C2)O3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.66
CB1 binding score: -15.786
InChIKey:MUIOWXLVANYALW-UHFFFAOYSA-N
ID: 86056
SMILES:C(=CCCCC)CCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: Not available
InChIKey:GBDPSNRFALSXEP-UHFFFAOYSA-N
ID: 86057
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C(C)(C)O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -17.942
InChIKey:PRKDRANYBPHDBW-UHFFFAOYSA-N
ID: 86058
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C(=O)O)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N