ID: 56533
SMILES:C(=O)(C)Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1=CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -15.562
InChIKey:WHTOMQKXBRDPDZ-UHFFFAOYSA-N
ID: 56534
SMILES:CC(COc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(C)CC1)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -15.562
InChIKey:JCSWRQOYJDJAHF-UHFFFAOYSA-N
ID: 56535
SMILES:C(CCCc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(OC)c1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -18.773
InChIKey:YBKJMWKLIGSBGR-UHFFFAOYSA-N
ID: 56536
SMILES:C(CCc1cc(O)cc2c1CC(O)C(C)(C)O2)C(C)=CCCC(O)(C=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -13.74
InChIKey:ZFEMYUKACUHQIQ-UHFFFAOYSA-N
ID: 56537
SMILES:c1(C2C(CO)C(CCCC)C(=O)C2C)c(C(=O)C)c(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.634
CB1 binding score: -14.207
InChIKey:IJXJGTRYXKELIE-UHFFFAOYSA-N
ID: 56538
SMILES:CC1(C)C2C(C=C(O)C(O)(C)C1)c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -13.755
InChIKey:NXKFYTKKYVRSBK-UHFFFAOYSA-N
ID: 56539
SMILES:CC1(C)C2C3C(C)(Oc4c(c(OC(=O)C)c(O)cc4CCCCC)C3C(OC)=O)CC2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.568
CB1 binding score: -15.612
InChIKey:XWADYTYSVVVSSR-UHFFFAOYSA-N
ID: 56540
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 56541
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 56542
SMILES:C(=C(C)C)CC1(CC=C(C)C)CC=C(C)CC1c1c(O)cc(CCCCC)c(C(=O)OC(C)=O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Polyprenylated cyclic polyketides (Hop meroterpenoids)
MW: 496.688
CB1 binding score: -16.124
InChIKey:DEDFTOXOXCJWAX-UHFFFAOYSA-N
ID: 56543
SMILES:O(C)c1cc2c(c(C)c1)C1=CC(C)(C)OC(C)(C)C1C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -15.385
InChIKey:IWSKBAUZCOLUOH-UHFFFAOYSA-N
ID: 56544
SMILES:OC(=O)c1c(CCCCC)cc2c(c1O)C1C(C(=C)C)CCC(C)(O2)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -13.717
InChIKey:DXISMIZIERSGSU-UHFFFAOYSA-N
ID: 56545
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 56546
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -15.566
InChIKey:ANMCHLHYRXJKON-UHFFFAOYSA-N
ID: 56547
SMILES:c1c(CCCC)cc(OC)c(CC=C(C)CCC=C(C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.625
InChIKey:NVVLJNOCFRRKFU-UHFFFAOYSA-N
ID: 56548
SMILES:C12(C)CCC(O1)C(CCC=C(C)C)(C)Oc1c2c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.718
InChIKey:IEFCZZAEEQLPEV-UHFFFAOYSA-N
ID: 56549
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(CC)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -15.931
InChIKey:ZZVVRSMBJDMIML-UHFFFAOYSA-N
ID: 56550
SMILES:C(C)CCCCc1cc2c(c(O)c1C=O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.195
InChIKey:ZUCNOXJMBLPRBT-UHFFFAOYSA-N
ID: 56551
SMILES:C(c1cc(OC)c2c(c1)OC(C)(C)C1C2C(=O)C(C)=CC1O)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.081
InChIKey:SWKFWKGAAZQCRE-UHFFFAOYSA-N
ID: 56552
SMILES:C1c2c(O)c(C(O)=O)c(CCCCC)cc2OC(C)(CCC=C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -17.201
InChIKey:WRDOPLLDCBRWNW-UHFFFAOYSA-N
ID: 56553
SMILES:C1C(COC(=O)CCC(=O)O)=CC2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.55
CB1 binding score: -16.879
InChIKey:AAXISUXJDWALKK-UHFFFAOYSA-N