ID: 79276
SMILES:c1(CCCCC)cc(CC2OC2(CCCC(C)C)C)cc(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -13.933
InChIKey:ZRYZGEHMIXCGLT-UHFFFAOYSA-N
ID: 79277
SMILES:O=C(C(C)C)Oc1cc(C)c2c(c1OC)C1C(C(C)(C)O2)CC=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.45
InChIKey:BZBVVUZIMPGAGY-UHFFFAOYSA-N
ID: 79278
SMILES:C(=O)(C)Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -18.022
InChIKey:ZAZIHGFBNRVMAI-UHFFFAOYSA-N
ID: 79279
SMILES:COc1c(OC)c(Cc2c(CCC(CCC=C(C)C)C)c3c(c(O)c2)CC2(OC2=O)OC(C)(C)CC3)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 552.708
CB1 binding score: -13.668
InChIKey:DJJWNNDVNWDEFM-UHFFFAOYSA-N
ID: 79280
SMILES:c12c(C(=O)OC)c(OC)cc(CCCCC)c1C1C(C(C)(C)O2)CC(O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -14.558
InChIKey:AVOHIKIABURIFP-UHFFFAOYSA-N
ID: 79281
SMILES:c1(CCC)c(C)c2c(c(OC)c1)C=CC(C)(CCC=C(C)C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -11.593
InChIKey:KWXVWBTVOADPFS-UHFFFAOYSA-N
ID: 79282
SMILES:C1=C(C)CCC(C(C)=C)C1c1c(OC)c(OC)ccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -17.754
InChIKey:BPKVPHCRXMFJSH-UHFFFAOYSA-N
ID: 79283
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)cc(OC)c3C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.945
InChIKey:HDHGWQGTUUGVIW-UHFFFAOYSA-N
ID: 79284
SMILES:c1(-c2c(O)cc(CCCCC)c(C(=O)O)c2)cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.591
CB1 binding score: -13.922
InChIKey:PVKMFFYWIPHCJP-UHFFFAOYSA-N
ID: 79285
SMILES:C(CC(=CC(CC(CC)C)c1c(O)c(O)c(C=O)c(O)c1)C)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -12.782
InChIKey:JPFWFMJGEMWPKU-UHFFFAOYSA-N
ID: 79286
SMILES:C1(C)=C2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(C)C2CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -12.816
InChIKey:ZDOMMHANIDWZLL-UHFFFAOYSA-N
ID: 79287
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 79288
SMILES:C12=C(C)CCC1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.524
InChIKey:USODFRMMCODFKQ-UHFFFAOYSA-N
ID: 79289
SMILES:C(CCCC)Cc1ccc2c(c1O)CC(O)C(=C)CCC(O)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -15.528
InChIKey:KFZZFPWCCQCCGE-UHFFFAOYSA-N
ID: 79290
SMILES:c1c(O)c(CCC)cc2c1C1C=C(COC(=O)C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.848
InChIKey:UBRBJXGUOTYRIH-UHFFFAOYSA-N
ID: 79291
SMILES:C12c3c(cc(CCCCC)cc3O)OC(C)(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -17.624
InChIKey:SFKCWCDDXYSANA-UHFFFAOYSA-N
ID: 79292
SMILES:C1=Cc2c(O)cc(CCCCC)cc2OC1(O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.322
CB1 binding score: -17.794
InChIKey:VJJHPMHMZFASTR-UHFFFAOYSA-N
ID: 79293
SMILES:C(=C(C)C)CCC(=CCCC(C)(CC)c1c(OCOC)cc(Br)c(O)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 439.434
CB1 binding score: -15.383
InChIKey:WBAKGDYBCZNFAY-UHFFFAOYSA-N
ID: 79294
SMILES:c1(CC=C(CCC=C(C=O)C)C)c(O)cc(CCCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.491
InChIKey:XHHKTQPFVOZAMX-UHFFFAOYSA-N
ID: 79295
SMILES:CC(C)CC(c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.055
InChIKey:OAEMYZLSFWZUEY-UHFFFAOYSA-N
ID: 79296
SMILES:Oc1c(O)c(C(C)C)c2c(c1CC(CCCCC)C)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.63
CB1 binding score: -15.768
InChIKey:QMKVQIBOWFQUSM-UHFFFAOYSA-N