ID: 48532
SMILES:C1=CC(C)(C)Oc2c1c(O)cc(CCC)c2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 218.296
CB1 binding score: -17.978
InChIKey:CHBXMMKWGIOKEK-UHFFFAOYSA-N
ID: 48533
SMILES:C1CC(C)C2C1c3c(O)cc(CCCCC)cc3OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.748
InChIKey:KVIUZCORYUKBDQ-UHFFFAOYSA-N
ID: 48534
SMILES:CC(=CCc1c(CC(O)CC(=O)c2ccccc2)c2c(cc1C)C1C(CCC(C)=C1)C(C)(C)O2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.669
CB1 binding score: -15.769
InChIKey:YVZRLWOLXJIVLQ-UHFFFAOYSA-N
ID: 48535
SMILES:C(c1cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 48536
SMILES:O(c1cc(OC)c2c(c1Cl)OC(C)(C)C1CCC(C)=CC21)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.886
CB1 binding score: -13.881
InChIKey:YDDLLRNREAPYKK-UHFFFAOYSA-N
ID: 48537
SMILES:C1CC2(C)Oc3c(c(OC)cc(CCCCC)c3)C3C2C(C(C)C)CCC3(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.631
CB1 binding score: -12.914
InChIKey:JKAIGJNNSWZSAU-UHFFFAOYSA-N
ID: 48538
SMILES:c1(CCCCC)cc2c(cc1)OC(C)(C)C1CC=C(CO)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.655
InChIKey:JPUAIMBMIKYBHB-UHFFFAOYSA-N
ID: 48539
SMILES:C1(C)C2C=CC(=C)CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -16.8
InChIKey:XRHJGIURANSAGG-UHFFFAOYSA-N
ID: 48540
SMILES:C(C[n+]1cncc(-c2ccccc2)c1)(Oc1c2c(cc(C)c1)OC(C)(C)C1CCC(C)=CC21)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 455.578
CB1 binding score: -15.327
InChIKey:JDTWSDSYMSQCND-UHFFFAOYSA-N
ID: 48541
SMILES:C(CCC(C)=CCc1c(O)cc(CCCCC)c(O)c1O)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.433
InChIKey:PQJHNORQVFURSH-UHFFFAOYSA-N
ID: 48542
SMILES:Oc1c2c(cc(C)c1)OC(C)(C)c1CC(OC(C)=O)CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -15.264
InChIKey:YWQUGSOCEKDHMW-UHFFFAOYSA-N
ID: 48543
SMILES:CC1=CC(c2c(OC(C)=O)cc(CCCCC)cc2OC(CCCCCCC)=O)C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.721
CB1 binding score: -16.502
InChIKey:DKZYRPHRVULWPT-UHFFFAOYSA-N
ID: 48544
SMILES:C12C(C)(C)C(Cc3c(O)cc(CCCCC)c(OC)c3OC1(C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -12.391
InChIKey:OLMWOQWWYBXWQT-UHFFFAOYSA-N
ID: 48545
SMILES:CC12OC1c1c(ccc(CCCCC)c1)OC2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -13.676
InChIKey:IFNUARNWBCJGLZ-UHFFFAOYSA-N
ID: 48546
SMILES:CC1C2=C(c3c(cc(CCCCC)cc3O)OC2(C)C)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -14.273
InChIKey:FHZUNTFIBRNQSL-UHFFFAOYSA-N
ID: 48547
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CCC(C(=O)OC)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.943
InChIKey:CCMWHLPOQSRJEP-UHFFFAOYSA-N
ID: 48548
SMILES:c12c(CCCCC)cc(O)c3c1OOC1(C3(C)C(C)CCC1)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -13.674
InChIKey:RDWMXNIIPWTYMS-UHFFFAOYSA-N
ID: 48549
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C(=O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -18.771
InChIKey:VGSHJKOXKGYENI-UHFFFAOYSA-N
ID: 48550
SMILES:C1(C(O)(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.812
InChIKey:FTDORWGKHUOHKJ-UHFFFAOYSA-N
ID: 48551
SMILES:CC(C1CCC2(C)Oc3c(C(C(C)=CC)=O)c(O)cc(O)c3C1C2=O)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.418
CB1 binding score: -15.929
InChIKey:IDAZKHKBXYSPSV-UHFFFAOYSA-N
ID: 48552
SMILES:c1(O)c(C(O)=O)c(CCCCC)cc2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.507
InChIKey:YKKHSYLGQXKVMO-UHFFFAOYSA-N